IBS-ZINC05206896 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -3.2160 1.7750 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 0.5040 -0.1770 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8180 0.3740 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 -0.6840 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 -1.7870 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -1.9850 1.1230 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4940 -2.5500 2.5470 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4840 -2.7110 2.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 -3.8840 2.4940 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4980 -3.7580 1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7350 -2.8100 0.8510 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5520 -4.8220 1.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -4.3060 3.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 -3.9270 4.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -5.1040 4.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -5.3860 5.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -5.2470 6.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 -5.5300 7.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -5.9440 8.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -6.0600 7.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 -5.7880 6.7250 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -1.5870 3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -1.3640 3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2510 -0.4820 4.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 0.1800 5.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 -0.0440 5.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 -0.9320 4.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 1.0490 5.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -0.7070 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -0.7310 1.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 0.6150 0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5670 2.6360 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9200 1.6920 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7650 1.9030 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -0.6320 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -4.6410 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -2.7090 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2850 -4.4940 2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0500 -4.9930 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 -5.7460 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -5.4820 4.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1320 -4.9220 5.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 -5.4300 8.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6850 -6.1720 9.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -6.3810 8.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1090 -1.8800 2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3070 -0.3090 3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 0.4700 6.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -1.1110 4.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 0.6400 6.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 1.4200 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9210 0.8060 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END